REMARK VINA RESULT: -4.4 2.090 5.289 REMARK 9 active torsions: REMARK status: ('A' for Active; 'I' for Inactive) REMARK 1 A between atoms: O_1 and C_7 REMARK 2 A between atoms: O_1 and C_11 REMARK 3 A between atoms: O_2 and C_13 REMARK 4 A between atoms: O_2 and C_16 REMARK 5 A between atoms: C_5 and C_6 REMARK 6 A between atoms: C_5 and C_7 REMARK 7 A between atoms: C_8 and C_11 REMARK 8 A between atoms: C_9 and C_16 REMARK 9 A between atoms: C_13 and C_14 ROOT ATOM 1 C UNL d 1 21.179 -31.525 1.136 0.00 0.00 0.055 A ATOM 2 C UNL d 1 21.226 -32.681 0.342 0.00 0.00 0.055 A ATOM 3 C UNL d 1 20.933 -31.628 2.513 0.00 0.00 0.018 A ATOM 4 C UNL d 1 20.957 -33.924 0.932 0.00 0.00 0.018 A ATOM 5 C UNL d 1 20.685 -32.874 3.091 0.00 0.00 0.001 A ATOM 6 C UNL d 1 20.682 -34.020 2.300 0.00 0.00 0.001 A ENDROOT BRANCH 2 7 ATOM 7 C UNL d 1 21.519 -32.666 -1.111 0.00 0.00 0.294 C ATOM 8 O UNL d 1 22.651 -32.553 -1.556 0.00 0.00 -0.259 OA BRANCH 7 9 ATOM 9 O UNL d 1 20.369 -32.724 -1.823 0.00 0.00 -0.313 OA BRANCH 9 10 ATOM 10 C UNL d 1 20.505 -32.603 -3.248 0.00 0.00 0.217 C BRANCH 10 11 ATOM 11 C UNL d 1 19.342 -31.795 -3.753 0.00 0.00 -0.034 A ATOM 12 C UNL d 1 18.060 -32.357 -3.790 0.00 0.00 0.009 A ATOM 13 C UNL d 1 17.028 -31.708 -4.464 0.00 0.00 0.001 A ATOM 14 C UNL d 1 17.268 -30.488 -5.095 0.00 0.00 0.000 A ATOM 15 C UNL d 1 18.524 -29.891 -5.009 0.00 0.00 0.001 A ATOM 16 C UNL d 1 19.557 -30.538 -4.333 0.00 0.00 0.009 A ENDBRANCH 10 11 ENDBRANCH 9 10 ENDBRANCH 7 9 ENDBRANCH 2 7 BRANCH 1 17 ATOM 17 C UNL d 1 21.271 -30.154 0.579 0.00 0.00 0.294 C ATOM 18 O UNL d 1 22.320 -29.590 0.332 0.00 0.00 -0.259 OA BRANCH 17 19 ATOM 19 O UNL d 1 20.026 -29.632 0.559 0.00 0.00 -0.317 OA BRANCH 19 20 ATOM 20 C UNL d 1 19.338 -29.590 -0.699 0.00 0.00 0.179 C BRANCH 20 21 ATOM 21 C UNL d 1 18.083 -30.448 -0.569 0.00 0.00 0.026 C BRANCH 21 22 ATOM 22 C UNL d 1 16.892 -29.784 -1.264 0.00 0.00 -0.002 C ATOM 23 C UNL d 1 17.250 -28.447 -1.886 0.00 0.00 0.005 C ENDBRANCH 21 22 ENDBRANCH 20 21 ENDBRANCH 19 20 ENDBRANCH 17 19 ENDBRANCH 1 17 TORSDOF 9